Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 2/20 | 0.43 |
| ▸ | CMA1 | P23946 | 1/20 | 0.43 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.43 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.43 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1607899 | 1.00 | NLRP3 (0.53) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| SCHEMBL30006673 | 0.86 | HDAC1 (0.54) | KDM4EALDH1A1ENPP2CA2CYP2A6 | |
| SCHEMBL9225433 | 0.86 | HDAC1 (0.54) | KDM4EALDH1A1ENPP2CA2CYP2A6 | |
| SCHEMBL29627552 | 0.84 | KDM4E (0.56) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| SCHEMBL3105331 | 0.84 | KDM4E (0.56) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| SCHEMBL21274689 | 0.83 | BACE1 (0.50) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| Water SCHEMBL8810335 | 0.83 | KDM4E (0.54) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| SCHEMBL10645020 | 0.79 | NLRP3 (0.60) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| SCHEMBL6675330 | 0.79 | NLRP3 (0.64) | NLRP3KDM4EALDH1A1ENPP2HPGD | |
| SCHEMBL11976503 | 0.79 | NLRP3 (0.53) | NLRP3KDM4EALDH1A1ENPP2HPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4103278-A1 | SMALL MOLECULE STING ANTAGONISTS | Curadev Pharma Pvt. Ltd. (IN) | 2022-12-21 | — | — | EP | claimed |
| EP-4337642-A1 | ETHACRYNIC ACID DERIVATIVES AS INHIBITORS OF MPRO PROTEASE AND SARS-COV-2 REPLICATION | Universite Euro-Mediterraneenne de Fes (MA) | 2024-03-20 | — | — | EP | disclosed |
| CN-116554050-A | Amide phenol derivative and application thereof | 四川大学 | 2023-08-08 | — | — | CN | disclosed |
| EP-4103278-A1 | SMALL MOLECULE STING ANTAGONISTS | Curadev Pharma Pvt. Ltd. (IN) | 2022-12-21 | — | — | EP | disclosed |
| CN-115427044-A | Pyrrolopyrimidines as complement inhibitors | 拜奥克里斯特制药公司 | 2022-12-02 | — | — | CN | disclosed |
| WO-2022240277-A1 | ETHACRYNIC ACID DERIVATIVES AS INHIBITORS OF MPRO PROTEASE AND SARS-COV-2 REPLICATION | UNIVERSITE EURO-MEDITERRANEENNE DE FES (MA) | 2022-11-17 | — | — | WO | disclosed |